[CP2K:4375] FORCE_MIXING and QM TEMPERATURE

Noam Bernstein no... at bollweevil.gdbg.org
Thu Apr 11 16:32:08 CEST 2013


Thanks.  I'll take a look  Are you planning to try to deal with,
or are you letting me know because you want me to do it?


On Thu, Apr 11, 2013 at 10:28 AM, Teodoro Laino <teodor... at gmail.com>wrote:

> I've just opened a ticket so that this issue will not get lost.
> You can have a look at the status of the ticket on this page:
>
> https://sourceforge.net/p/cp2k/bugs/
>
> cheers
>
> On Apr 11, 2013, at 4:23 PM, Teodoro Laino <teodor... at gmail.com>
> wrote:
>
> OK - thanks for reporting.
> we will look into that.
>
> cheers
> teo
>
> On Apr 11, 2013, at 4:22 PM, Pietro Vidossich <vi... at klingon.uab.es> wrote:
>
>  yes. pietro
>
>
> *On Thu, 11 Apr 2013 16:18:35 +0200, Teodoro Laino wrote*
> > Are you doing adaptive QMMM?
> >
> > On Apr 11, 2013, at 4:11 PM, Pietro Vidossich <vi... at klingon.uab.es>
> wrote:
>
> rebuilding the QM/MM calculation
>
>
> >
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